2-[4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]phenyl]carbonyloxypropanoic acid

Systemtic Name: 2-[4-[(16-methoxy-16-oxidanylidene-hexadecyl)amino]phenyl]carbonyloxypropanoic acid Openeye Name: 2-[4-[(16-methoxy-16-oxo-hexadecyl)amino]benzoyl]oxypropanoic acid CAS Name: 2-[[4-[(16-methoxy-16-oxohexadecyl)amino]phenyl]-oxomethoxy]propanoic acid IUPAC Name: 2-[4-[(16-methoxy-16-oxohexadecyl)amino]benzoyl]oxypropanoic acid Traditional Name: 2-[4-[(16-keto-16-methoxy-hexadecyl)amino]benzoyl]oxypropionic acid Formula: C27H43NO6 MolecularWeight: 477.63342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC(=O)C1=CC=C(C=C1)NCCCCCCCCCCCCCCCC(=O)OC

Isomeric SMILES

CC(C(=O)O)OC(=O)C1=CC=C(C=C1)NCCCCCCCCCCCCCCCC(=O)OC

InChI

InChI=1S/C27H43NO6/c1-22(26(30)31)34-27(32)23-17-19-24(20-18-23)28-21-15-13-11-9-7-5-3-4-6-8-10-12-14-16-25(29)33-2/h17-20,22,28H,3-16,21H2,1-2H3,(H,30,31)